Vitas-M small molecule compound
4-[(Z)-(6-benzyl-5-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]-2-methoxyphenyl acetate
Catalog ID
STK905146
SMILES COc1cc(ccc1OC(=O)C)/C=c/1\sc2n(c1=O)c(C)c(c(=O)n2)Cc1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C24H20N2O5S MW 448.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O5S/c1-14-18(11-16-7-5-4-6-8-16)22(28)25-24-26(14)23(29)21(32-24)13-17-9-10-19(31-15(2)27)20(12-17)30-3/h4-10,12-13H,11H2,1-3H3/b21-13-InChIKey
OCUMXTPBZKSGPJ-BKUYFWCQSA-NSynonyms
(4((Z)(6benzyl5methyl37dioxo(13)thiazolo(32a)pyrimidin2ylidene)methyl)2methoxyphenyl)acetate
4((Z)(6benzyl5methyl37dioxo7H(13)thiazolo(32a)pyrimidin2(3H)ylidene)methyl)2methoxyphenylacetate
CC1=C(C(=O)N=C2N1C(=O)C(=CC3=CC(=C(C=C3)OC(=O)C)OC)S2)CC4=CC=CC=C4
COc1cc(ccc1OC(=O)C)C=c1sc2n(c1=O)c(C)c(c(=O)n2)Cc1ccccc1
InChI=1SC24H20N2O5Sc11418(11167546816)22(28)252426(14)23(29)21(3224)131791019(3115(2)27)20(1217)303h4101213H11H213H3b2113
MFCD18076269
ZINC000027022704
ZINC27022704
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